![2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) structure](/static/products/588/588680-76-6.png)
2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)
TL;DR: 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) (CAS 588680-76-6) is a chemical compound with molecular formula C21H21BrN2O4 and molecular weight 444.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-methyl-1-benzofuran-2-carboxamide
Also Known As: 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI), N-[(3-bromo-5-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]-3-methyl-benzofuran-2-carboxamide, N-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-methyl-1-benzofuran-2-carboxamide
| Molecular Formula | C21H21BrN2O4 |
|---|---|
| Molecular Weight | 444.07 g/mol |
| LogP | 5.06342 |
| Topological Polar Surface Area | 73.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.06848 |
| Heavy Atoms | 28 |
| Complexity | 1040.3068 |
Chemical Identifiers
| CAS Number | 588680-76-6 |
|---|---|
| SMILES | CC1=C(OC2=CC=CC=C12)C(=O)NN=CC3=CC(=C(C(=C3)Br)OC(C)C)OC |
Product Overview
2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) (CAS 588680-76-6), with molecular formula C21H21BrN2O4 and molecular weight 444.07 g/mol. IUPAC: N-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-methyl-1-benzofuran-2-carboxamide.
Chemical Property Profile of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)
Property Insights of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)
The XLogP value of 5.06342 indicates that 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI). Following Lipinski's Rule of Five, 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)?
The CAS number of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) is 588680-76-6.
What is the molecular formula of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)?
The molecular formula of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) is C21H21BrN2O4.
What is the molecular weight of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)?
The molecular weight of 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) is 444.07 g/mol.
Where can I buy 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)?
You can request a quote for 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI)?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzofurancarboxylic acid, 3-methyl-, [[3-bromo-5-methoxy-4-(1-methylethoxy)phenyl]methylene]hydrazide (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.